N-{2-[({1-[(2-chlorophenyl)methyl]-1H-pyrrol-2-yl}methyl)(2-methylpropyl)amino]-2-oxoethyl}-N-(3-ethoxypropyl)-4-nitrobenzamide
Chemical Structure Depiction of
N-{2-[({1-[(2-chlorophenyl)methyl]-1H-pyrrol-2-yl}methyl)(2-methylpropyl)amino]-2-oxoethyl}-N-(3-ethoxypropyl)-4-nitrobenzamide
N-{2-[({1-[(2-chlorophenyl)methyl]-1H-pyrrol-2-yl}methyl)(2-methylpropyl)amino]-2-oxoethyl}-N-(3-ethoxypropyl)-4-nitrobenzamide
Compound characteristics
| Compound ID: | V027-9646 |
| Compound Name: | N-{2-[({1-[(2-chlorophenyl)methyl]-1H-pyrrol-2-yl}methyl)(2-methylpropyl)amino]-2-oxoethyl}-N-(3-ethoxypropyl)-4-nitrobenzamide |
| Molecular Weight: | 569.1 |
| Molecular Formula: | C30 H37 Cl N4 O5 |
| Salt: | not_available |
| Smiles: | CCOCCCN(CC(N(CC(C)C)Cc1cccn1Cc1ccccc1[Cl])=O)C(c1ccc(cc1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1993 |
| logD: | 5.1993 |
| logSw: | -5.6852 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 75.812 |
| InChI Key: | GKFHCHAZYUTTFX-UHFFFAOYSA-N |